| SpectraBase Spectrum ID |
AaNeHsMlmL6 |
| Name |
methyl 2-({[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]carbonyl}amino)-4,5-dimethoxybenzoate |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C23H27ClN4O5/c1-31-17-5-15(19(29)33-3)16(6-18(17)32-2)26-20(30)22-7-13-4-14(8-22)10-23(9-13,11-22)28-12-25-21(24)27-28/h5-6,12-14H,4,7-11H2,1-3H3,(H,26,30) |
| InChIKey |
XSEIYRGPTOXCNW-UHFFFAOYSA-N |
| NMR Offset |
14.9921 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_20298 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: UZI/9161549; UBI_ID: UBI-020302 |
| Temperature |
313 °C |
![methyl 2-({[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]carbonyl}amino)-4,5-dimethoxybenzoate](/api/spectrum/AaNeHsMlmL6/structure.png?h=300&w=458 "methyl 2-({[3-(3-chloro-1H-1,2,4-triazol-1-yl)-1-adamantyl]carbonyl}amino)-4,5-dimethoxybenzoate")
